2-(fluoromethyl)-5-hydroxynonanal

C10H19FO2 — CID 134300098

IUPAC2-(fluoromethyl)-5-hydroxynonanal
SMILESCCCCC(O)CCC(C=O)CF
InChIInChI=1S/C10H19FO2/c1-2-3-4-10(13)6-5-9(7-11)8-12/h8-10,13H,2-7H2,1H3
InChIKeyDHRRLTZNDOBQKR-UHFFFAOYSA-N
MW190.26 g/mol
LogP2.10
Rot. Bonds8

About 2-(fluoromethyl)-5-hydroxynonanal

2-(fluoromethyl)-5-hydroxynonanal (PubChem CID 134300098) has the molecular formula C10H19FO2 and a molecular weight of 190.26 g/mol. Its IUPAC name is 2-(fluoromethyl)-5-hydroxynonanal.

Molecular Properties

Compound Name2-(fluoromethyl)-5-hydroxynonanal
PubChem CID134300098
Molecular FormulaC10H19FO2
Molecular Weight190.26 g/mol
Exact Mass190.14
IUPAC Name2-(fluoromethyl)-5-hydroxynonanal
SMILESCCCCC(O)CCC(C=O)CF
InChIInChI=1S/C10H19FO2/c1-2-3-4-10(13)6-5-9(7-11)8-12/h8-10,13H,2-7H2,1H3
InChIKeyDHRRLTZNDOBQKR-UHFFFAOYSA-N
XLogP2.10
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.26
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(3S)-3-hydroxyheptanal
CID 15258469
acetic acid;nonan-5-ol
CID 53445479
1-fluorohexan-2-ol
CID 11819078
CID 172776718
CID 172776718
N-(4-hydroxyoct-1-enyl)formamide
CID 57251657
6-hydroxydecanal
CID 86178467
ethane-1,2-diol;octan-4-ol
CID 174867706
4-hydroxyoctyl formate
CID 134918328
(5S)-octadecan-5-ol
CID 98231191
tritetracontan-5-ol
CID 162898528
icosane-5,11-diol
CID 170722582
icosane-5,10-diol
CID 170722579

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-5-hydroxynonanal?
The IUPAC name of 2-(fluoromethyl)-5-hydroxynonanal (CID 134300098) is 2-(fluoromethyl)-5-hydroxynonanal.
What is the SMILES notation for 2-(fluoromethyl)-5-hydroxynonanal?
The canonical SMILES for 2-(fluoromethyl)-5-hydroxynonanal is CCCCC(O)CCC(C=O)CF.
What is the InChIKey of 2-(fluoromethyl)-5-hydroxynonanal?
The InChIKey is DHRRLTZNDOBQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FO2/c1-2-3-4-10(13)6-5-9(7-11)8-12/h8-10,13H,2-7H2,1H3.
What are the key properties of 2-(fluoromethyl)-5-hydroxynonanal?
2-(fluoromethyl)-5-hydroxynonanal has a molecular weight of 190.26 g/mol, XLogP of 2.10, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-5-hydroxynonanal is sourced from PubChem (CID 134300098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).